4XYJ
Crystal structure of human phosphofructokinase-1 in complex with ATP and Mg, Northeast Structural Genomics Consortium Target HR9275
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NSLS BEAMLINE X4C |
| Synchrotron site | NSLS |
| Beamline | X4C |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2013-09-17 |
| Detector | MAR CCD 165 mm |
| Wavelength(s) | 0.97907 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 137.199, 159.329, 170.533 |
| Unit cell angles | 90.00, 104.20, 90.00 |
Refinement procedure
| Resolution | 49.690 - 3.100 |
| R-factor | 0.221 |
| Rwork | 0.221 |
| R-free | 0.24600 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3o8l |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.300 |
| Data reduction software | HKL-2000 |
| Data scaling software | SCALEPACK |
| Phasing software | MOLREP |
| Refinement software | CNS (1.3) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 49.690 | 3.210 |
| High resolution limit [Å] | 3.100 | 3.100 |
| Rmerge | 0.684 | |
| Number of reflections | 121790 | |
| <I/σ(I)> | 13.9 | 1.84 |
| Completeness [%] | 93.0 | 84.1 |
| Redundancy | 6.4 | 5.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | MICROBATCH | 7 | 293 | 200 mM potassium thiocyanate, pH 7, and 20% (w/v) PEG 3350 |
